Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 7/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.36 |
| ▸ | AHR | P35869 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | PPOX | P50336 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 2/20 | 0.31 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.31 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.30 |
| ▸ | WEE1 | P30291 | 1/20 | 0.30 |
| ▸ | CASP1 | P29466 | 1/20 | 0.30 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL11226468 | 0.92 | CES1 (0.41) | CES1ALDH1A1DNMT1AHRCYP3A4 | |
| SCHEMBL7943454 | 0.83 | CES1 (0.47) | CES1ALDH1A1DNMT1AHRCYP3A4 | |
| SCHEMBL11222151 | 0.77 | CES1 (0.47) | CES1DNMT1PPOXCHEK1WEE1 | |
| SCHEMBL3143690 | 0.76 | UCHL1 (0.35) | CES1ALDH1A1TSHR | |
| SCHEMBL11260122 | 0.71 | CES1 (0.47) | CES1PPOX | |
| SCHEMBL18663489 | 0.65 | GRIN2D (0.34) | ALDH1A1 | |
| SCHEMBL5888319 | 0.65 | CES1 (0.59) | CES1ALDH1A1DNMT1CYP3A4HPGD | |
| SCHEMBL18663501 | 0.65 | ALDH1A1 (0.33) | CES1ALDH1A1CYP3A4 | |
| SCHEMBL4456478 | 0.65 | ALDH1A1 (0.65) | ALDH1A1AHRCYP3A4HPGDTSHR | |
| SCHEMBL3143038 | 0.64 | — | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4318850-A | Carboxamide type azomethine pigment | ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) | 1982-03-09 | — | — | US | disclosed |